6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine

C12H15N5O — CID 103375000

IUPAC6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
SMILESCCc1nc(-c2ccc(OC)nn2)nc(N)c1C
InChIInChI=1S/C12H15N5O/c1-4-8-7(2)11(13)15-12(14-8)9-5-6-10(18-3)17-16-9/h5-6H,4H2,1-3H3,(H2,13,14,15)
InChIKeyCVGSHTWVVQQNPZ-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.40
Rot. Bonds3

About 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine

6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine (PubChem CID 103375000) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
PubChem CID103375000
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
SMILESCCc1nc(-c2ccc(OC)nn2)nc(N)c1C
InChIInChI=1S/C12H15N5O/c1-4-8-7(2)11(13)15-12(14-8)9-5-6-10(18-3)17-16-9/h5-6H,4H2,1-3H3,(H2,13,14,15)
InChIKeyCVGSHTWVVQQNPZ-UHFFFAOYSA-N
XLogP1.40
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
CID 103375001
5-bromo-2-(6-methoxypyridazin-3-yl)-6-propylpyrimidin-4-amine
CID 103375014
5-bromo-6-(methoxymethyl)-2-(6-methoxypyridazin-3-yl)pyrimidin-4-amine
CID 103375038
2-(6-methoxypyridazin-3-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103374942
5-(chloromethyl)-4-ethyl-2-(6-methoxypyridazin-3-yl)pyrimidine
CID 114205394
6-ethyl-5-iodo-2-(6-methoxypyridazin-3-yl)-N-propylpyrimidin-4-amine
CID 103375031
2-(6-methoxypyridazin-3-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 103374994
6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806721
6-ethyl-2-(4-ethylsulfanylphenyl)-5-methylpyrimidin-4-amine
CID 106849539
6-ethyl-5-methyl-2-pyridin-3-ylpyrimidin-4-amine
CID 63560551
2-(6-methoxypyridazin-3-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 103374966
2-(3-bromothiophen-2-yl)-6-ethyl-5-methylpyrimidin-4-amine
CID 115381177

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine (CID 103375000) is 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine is CCc1nc(-c2ccc(OC)nn2)nc(N)c1C.
What is the InChIKey of 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine?
The InChIKey is CVGSHTWVVQQNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-4-8-7(2)11(13)15-12(14-8)9-5-6-10(18-3)17-16-9/h5-6H,4H2,1-3H3,(H2,13,14,15).
What are the key properties of 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine?
6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine has a molecular weight of 245.29 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 103375000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).